#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qgp s GLU 7 N 0.00 1.05 1.09 5.55 4.04 -1.26 -4.05 118.70 125.11 2qgp s GLU 7 Ca 0.00 -1.52 -0.12 0.00 0.04 0.00 0.00 54.97 53.37 2qgp s GLU 7 Cb 0.00 -2.34 0.24 0.00 0.02 0.00 0.00 34.13 32.05 2qgp s GLU 7 CO 0.00 -1.03 1.07 0.08 -1.84 0.00 0.00 175.26 173.54 2qgp s VAL 8 N 1.09 2.00 0.00 1.83 1.01 0.14 -5.00 120.40 121.47 2qgp s VAL 8 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.10 2qgp s VAL 8 Cb -0.20 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.18 2qgp s VAL 8 CO -0.14 -0.00 0.00 -1.54 0.00 0.00 0.00 175.10 173.42 2qgp n SER 9 N -4.75 0.00 0.00 3.32 3.41 -1.26 -4.92 113.62 109.41 2qgp n SER 9 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 2qgp n SER 9 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 2qgp n SER 9 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2qgp n GLU 10 N 0.00 2.28 0.10 4.33 4.07 -1.26 -4.47 120.64 125.69 2qgp n GLU 10 Ca 0.00 0.00 -0.13 0.00 -0.06 0.00 0.00 57.16 56.97 2qgp n GLU 10 Cb 0.00 -0.75 -0.08 0.00 -0.06 0.00 0.00 31.44 30.55 2qgp n GLU 10 CO 0.00 0.00 0.00 0.37 -0.06 0.00 0.00 177.13 177.44 2qgp h GLN 11 N 0.00 -0.24 -0.42 5.31 4.15 -2.00 -1.90 115.11 120.01 2qgp h GLN 11 Ca 0.00 0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.42 2qgp h GLN 11 Cb 0.35 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.08 2qgp h GLN 11 CO 0.00 0.05 0.20 0.93 -1.93 0.00 0.00 178.83 178.08 2qgp h GLU 12 N -0.54 0.61 -0.17 1.69 4.39 -1.90 -1.17 114.58 117.49 2qgp h GLU 12 Ca -0.03 -0.09 0.05 0.00 0.34 0.00 0.00 59.36 59.63 2qgp h GLU 12 Cb 0.40 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 2qgp h GLU 12 CO 0.04 0.53 0.34 0.28 -1.16 0.00 0.00 179.01 179.04 2qgp h VAL 13 N 0.54 0.20 0.17 3.13 2.07 -1.76 0.38 116.25 120.99 2qgp h VAL 13 Ca 0.14 0.00 -0.31 0.00 0.82 0.00 0.00 66.70 67.35 2qgp h VAL 13 Cb 0.13 0.70 0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2qgp h VAL 13 CO -0.02 0.00 -1.32 0.11 0.02 0.00 0.00 177.57 176.36 2qgp h LYS 14 N 0.00 0.59 -7.36 1.57 1.79 -0.38 -3.36 116.57 109.43 2qgp h LYS 14 Ca 0.08 -0.87 -0.50 0.00 -2.18 0.00 0.00 60.65 57.19 2qgp h LYS 14 Cb 0.76 0.30 0.11 0.00 -1.58 0.00 0.00 32.23 31.82 2qgp h LYS 14 CO -0.00 1.40 0.33 1.03 -1.08 0.00 0.00 179.45 181.13 2qgp s ARG 15 N -2.83 2.24 -0.59 3.15 0.52 0.13 -2.58 118.95 118.99 2qgp s ARG 15 Ca -0.09 0.84 0.00 0.00 -0.52 0.00 0.00 55.73 55.96 2qgp s ARG 15 Cb 0.05 -1.92 0.00 0.00 0.52 0.00 0.00 34.95 33.60 2qgp s ARG 15 CO 0.94 -1.56 0.00 0.39 0.02 0.00 0.00 175.30 175.09 2qgp n GLU 16 N -3.42 -1.83 -0.00 3.54 1.02 -1.26 -4.37 120.64 114.32 2qgp n GLU 16 Ca 0.07 0.64 0.02 0.00 -0.02 0.00 0.00 57.16 57.87 2qgp n GLU 16 Cb 0.55 -4.94 -0.02 0.00 -0.02 0.00 0.00 31.44 27.00 2qgp n GLU 16 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2qgp n LYS 17 N -0.03 3.03 0.00 3.49 3.00 -1.07 -3.88 118.16 122.70 2qgp n LYS 17 Ca -0.06 -0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.24 2qgp n LYS 17 Cb 0.50 -0.86 0.00 0.00 0.00 0.00 0.00 35.03 34.66 2qgp n LYS 17 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 2qgp n GLU 18 N -1.34 2.73 0.03 1.64 0.28 -1.17 -4.15 120.64 118.66 2qgp n GLU 18 Ca 0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.16 57.11 2qgp n GLU 18 Cb 0.07 -0.98 0.47 0.00 1.43 0.00 0.00 31.44 32.43 2qgp n GLU 18 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 2qgp n LYS 19 N -1.78 0.07 0.00 3.44 4.81 -1.26 -1.52 118.16 121.92 2qgp n LYS 19 Ca 0.00 0.16 -0.20 0.00 -0.87 0.00 0.00 58.31 57.40 2qgp n LYS 19 Cb 0.33 -1.60 -0.14 0.00 0.02 0.00 0.00 35.03 33.65 2qgp n LYS 19 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2qgp h ALA 20 N 2.68 0.10 0.00 3.14 0.00 -1.77 -3.25 119.26 120.15 2qgp h ALA 20 Ca 0.00 -0.95 -0.01 0.00 0.00 0.00 0.00 54.91 53.95 2qgp h ALA 20 Cb 0.44 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2qgp h ALA 20 CO 0.00 0.63 -0.07 0.00 0.00 0.00 0.00 179.25 179.81 2qgp h ARG 21 N -0.45 0.00 0.00 0.00 2.47 -1.60 0.29 114.38 115.09 2qgp h ARG 21 Ca -0.24 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.48 2qgp h ARG 21 Cb 1.62 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.94 2qgp h ARG 21 CO 0.05 0.07 0.00 0.39 0.56 0.00 0.00 179.97 181.04 2qgp n GLU 22 N -3.74 0.05 0.02 0.04 1.02 -0.58 -2.89 120.64 114.55 2qgp n GLU 22 Ca -0.02 0.10 -0.19 0.00 -0.02 0.00 0.00 57.16 57.03 2qgp n GLU 22 Cb 0.17 -1.56 -0.14 0.00 -0.02 0.00 0.00 31.44 29.89 2qgp n GLU 22 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2qgp h LEU 23 N 0.00 0.38 -0.58 -4.62 6.46 -0.48 -3.31 115.31 113.16 2qgp h LEU 23 Ca 0.00 -0.79 0.00 0.00 -0.12 0.00 0.00 57.88 56.97 2qgp h LEU 23 Cb 0.48 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.28 2qgp h LEU 23 CO 0.00 1.70 0.00 0.54 -0.62 0.00 0.00 178.44 180.06 2qgp n ARG 24 N -3.43 0.08 0.00 1.25 1.74 -0.90 -0.64 116.66 114.76 2qgp n ARG 24 Ca -0.28 0.48 0.11 0.00 -0.77 0.00 0.00 57.85 57.39 2qgp n ARG 24 Cb 1.05 -1.72 0.00 0.00 -1.02 0.00 0.00 32.46 30.78 2qgp n ARG 24 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2qgp n ARG 25 N -1.88 0.82 -1.64 5.56 3.00 -1.21 -4.49 116.66 116.82 2qgp n ARG 25 Ca 0.01 -0.66 -0.31 0.00 -0.01 0.00 0.00 57.85 56.87 2qgp n ARG 25 Cb 0.09 -1.49 0.04 0.00 0.00 0.00 0.00 32.46 31.10 2qgp n ARG 25 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2qgp s SER 26 N -2.64 5.56 0.23 0.55 1.04 0.18 -4.93 113.70 113.69 2qgp s SER 26 Ca 0.16 1.59 -0.04 0.00 0.48 0.00 0.00 55.95 58.14 2qgp s SER 26 Cb 0.18 -2.49 0.22 0.00 0.10 0.00 0.00 66.02 64.03 2qgp s SER 26 CO 0.65 -1.32 1.67 -0.61 0.98 0.00 0.00 173.24 174.61 2qgp h GLN 27 N -0.60 0.79 0.00 4.02 5.75 -1.92 -2.63 115.11 120.52 2qgp h GLN 27 Ca -0.44 -0.28 0.02 0.00 -0.15 0.00 0.00 58.65 57.79 2qgp h GLN 27 Cb 1.21 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 29.65 2qgp h GLN 27 CO 0.58 0.90 -0.48 2.35 -2.65 0.00 0.00 178.83 179.52 2qgp h TRP 28 N 0.71 -1.41 -0.82 3.99 7.01 -1.92 -0.25 115.95 123.27 2qgp h TRP 28 Ca 0.11 0.04 -0.00 0.00 2.11 0.00 0.00 58.89 61.16 2qgp h TRP 28 Cb 0.65 0.61 -0.04 0.00 -2.10 0.00 0.00 29.16 28.28 2qgp h TRP 28 CO 0.03 -0.51 0.51 2.35 -2.79 0.00 0.00 178.44 178.03 2qgp h TRP 29 N -0.61 1.06 -0.31 2.65 2.91 -1.72 -0.79 115.95 119.16 2qgp h TRP 29 Ca 0.01 0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.06 2qgp h TRP 29 Cb 0.65 -0.35 -0.03 0.00 -0.51 0.00 0.00 29.16 28.92 2qgp h TRP 29 CO -0.50 0.70 0.15 0.87 -1.03 0.00 0.00 178.44 178.63 2qgp h LYS 30 N 1.12 0.31 -0.44 2.65 1.57 -1.06 -1.58 116.57 119.14 2qgp h LYS 30 Ca 0.30 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.96 2qgp h LYS 30 Cb -0.07 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 2qgp h LYS 30 CO -0.06 0.20 -0.13 -0.91 -0.57 0.00 0.00 179.45 177.99 2qgp h ASN 31 N 0.32 0.80 0.05 0.86 -0.26 -0.88 -0.61 115.58 115.86 2qgp h ASN 31 Ca 0.13 -0.25 -0.01 0.00 -0.56 0.00 0.00 56.30 55.61 2qgp h ASN 31 Cb 0.04 -0.22 -0.00 0.00 -1.06 0.00 0.00 38.32 37.09 2qgp h ASN 31 CO -0.09 0.94 -0.05 0.03 -1.06 0.00 0.00 177.43 177.20 2qgp h ARG 32 N 0.72 0.00 0.00 0.81 2.47 -0.46 -0.93 114.38 116.99 2qgp h ARG 32 Ca 0.12 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.84 2qgp h ARG 32 Cb 0.62 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.94 2qgp h ARG 32 CO 0.04 0.05 -1.11 0.44 0.56 0.00 0.00 179.97 179.95 2qgp n ILE 33 N -4.45 0.39 0.20 2.04 -5.35 -0.66 -3.29 119.36 108.24 2qgp n ILE 33 Ca -0.03 -0.43 -0.14 0.00 -0.27 0.00 0.00 62.75 61.87 2qgp n ILE 33 Cb 0.13 -0.13 -0.08 0.00 -1.74 0.00 0.00 39.64 37.82 2qgp n ILE 33 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qgp h ALA 34 N 2.19 -0.48 -0.88 -1.28 0.00 0.20 -2.69 119.26 116.32 2qgp h ALA 34 Ca 0.00 -0.16 0.18 0.00 0.00 0.00 0.00 54.91 54.92 2qgp h ALA 34 Cb 0.90 0.19 -0.11 0.00 0.00 0.00 0.00 17.79 18.77 2qgp h ALA 34 CO 0.00 -0.67 0.44 0.00 0.00 0.00 0.00 179.25 179.02 2qgp h ARG 35 N -0.69 0.54 -0.05 0.00 3.08 -1.43 -3.44 114.38 112.38 2qgp h ARG 35 Ca -0.05 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 2qgp h ARG 35 Cb 0.49 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2qgp h ARG 35 CO 0.08 0.36 -0.02 0.41 -1.07 0.00 0.00 179.97 179.73 2qgp n GLY 36 N -1.33 0.49 3.63 0.04 0.00 -1.01 -4.74 105.19 102.27 2qgp n GLY 36 Ca 0.19 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 2qgp n GLY 36 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qgp s ILE 37 N -2.01 4.92 0.15 -0.61 1.01 -1.26 0.57 121.20 123.97 2qgp s ILE 37 Ca 0.00 1.29 -0.30 0.00 0.00 0.00 0.00 60.65 61.64 2qgp s ILE 37 Cb 0.00 -4.01 -0.07 0.00 0.01 0.00 0.00 42.46 38.39 2qgp s ILE 37 CO 0.00 -0.02 1.20 0.00 0.00 0.00 0.00 174.94 176.11 2qgp h HIS 39 N 5.74 1.12 0.00 0.00 2.76 -1.34 -1.76 115.15 121.67 2qgp h HIS 39 Ca -0.44 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 2qgp h HIS 39 Cb 1.21 -0.37 0.00 0.00 1.55 0.00 0.00 27.41 29.80 2qgp h HIS 39 CO 0.64 0.60 -0.06 1.88 -1.30 0.00 0.00 177.93 179.69 2qgp h TYR 40 N 1.12 0.00 0.00 5.26 0.05 -1.92 -3.39 116.97 118.08 2qgp h TYR 40 Ca 0.40 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.18 2qgp h TYR 40 Cb 0.13 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.87 2qgp h TYR 40 CO -0.00 0.00 -0.46 0.00 -1.05 0.00 0.00 178.16 176.65 2qgp n GLY 42 N 1.34 0.41 3.88 0.00 0.00 -0.66 -5.01 105.19 105.15 2qgp n GLY 42 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 2qgp n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qgp s GLU 43 N -0.56 3.59 -0.05 1.61 0.41 -1.26 -4.65 118.70 117.79 2qgp s GLU 43 Ca 0.00 0.55 -0.11 0.00 -0.41 0.00 0.00 54.97 55.01 2qgp s GLU 43 Cb 0.00 -2.19 -0.05 0.00 -1.78 0.00 0.00 34.13 30.11 2qgp s GLU 43 CO 0.00 -0.42 0.28 0.42 -0.49 0.00 0.00 175.26 175.05 2qgp s ILE 44 N -2.99 5.26 0.14 -1.63 1.01 -1.26 -0.78 121.20 120.95 2qgp s ILE 44 Ca 0.52 0.50 -0.06 0.00 0.00 0.00 0.00 60.65 61.62 2qgp s ILE 44 Cb -0.11 -3.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.78 2qgp s ILE 44 CO 0.50 0.57 0.18 -0.36 0.00 0.00 0.00 174.94 175.83 2qgp s PHE 45 N -1.08 0.56 0.48 3.97 0.40 0.19 -4.98 117.98 117.53 2qgp s PHE 45 Ca 0.20 -0.94 -0.20 0.00 -0.60 0.00 0.00 56.93 55.40 2qgp s PHE 45 Cb -0.14 -0.23 -0.09 0.00 0.51 0.00 0.00 43.02 43.08 2qgp s PHE 45 CO 0.10 -0.63 1.01 -1.25 0.70 0.00 0.00 175.22 175.15 2qgp s PRO 46 N -3.99 3.88 0.34 0.24 0.04 -1.26 -4.24 135.00 130.01 2qgp s PRO 46 Ca 0.19 1.24 0.12 0.00 0.04 0.00 0.00 61.00 62.59 2qgp s PRO 46 Cb 0.05 -2.12 1.08 0.00 0.04 0.00 0.00 34.50 33.56 2qgp s PRO 46 CO -0.00 -0.34 1.58 -1.35 0.04 0.00 0.00 177.00 176.93 2qgp h PRO 47 N 1.48 0.02 -0.01 0.56 0.11 -1.85 -1.92 132.00 130.40 2qgp h PRO 47 Ca -0.49 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.63 2qgp h PRO 47 Cb 1.21 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2qgp h PRO 47 CO 0.60 0.02 -0.05 0.93 -0.21 0.00 0.00 178.00 179.28 2qgp h GLU 48 N 0.02 -0.09 -0.76 1.05 3.07 -1.92 -2.94 114.58 113.01 2qgp h GLU 48 Ca 0.74 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.60 2qgp h GLU 48 Cb 1.78 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.71 2qgp h GLU 48 CO -0.82 -0.06 0.00 0.39 -1.40 0.00 0.00 179.01 177.12 2qgp n GLU 49 N -5.17 0.66 -4.68 2.33 -0.58 -0.72 -4.68 120.64 107.79 2qgp n GLU 49 Ca -0.06 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.36 2qgp n GLU 49 Cb 0.10 -1.30 -0.17 0.00 -0.57 0.00 0.00 31.44 29.50 2qgp n GLU 49 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2qgp s LEU 50 N 0.00 2.03 0.00 -4.62 1.02 -1.11 -3.25 118.68 112.75 2qgp s LEU 50 Ca 0.00 -0.57 0.00 0.00 0.02 0.00 0.00 54.13 53.58 2qgp s LEU 50 Cb 0.00 -1.37 0.00 0.00 0.02 0.00 0.00 46.19 44.84 2qgp s LEU 50 CO 0.00 0.07 0.00 0.35 0.02 0.00 0.00 176.35 176.79 2qgp n THR 51 N 4.04 0.00 0.00 5.49 -2.24 0.11 -4.89 114.28 116.79 2qgp n THR 51 Ca -0.20 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2qgp n THR 51 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 2qgp n THR 51 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2qgp n ASP 53 N 0.00 0.00 -4.71 3.42 2.03 -0.55 -1.23 116.55 115.51 2qgp n ASP 53 Ca 0.00 0.00 -0.37 0.00 0.52 0.00 0.00 54.79 54.94 2qgp n ASP 53 Cb 0.00 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.33 2qgp n ASP 53 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2qgp s HIS 54 N -0.67 3.44 0.00 -0.67 3.76 -1.26 -0.33 115.29 119.56 2qgp s HIS 54 Ca 0.00 0.57 -0.11 0.00 -0.15 0.00 0.00 55.06 55.36 2qgp s HIS 54 Cb 0.00 -2.36 -0.06 0.00 1.11 0.00 0.00 32.58 31.27 2qgp s HIS 54 CO 0.00 0.19 0.86 -0.07 -0.85 0.00 0.00 174.74 174.87 2qgp h LEU 55 N 6.89 -0.35 -8.97 0.89 -0.00 -0.19 -3.39 115.31 110.19 2qgp h LEU 55 Ca -0.40 0.01 -0.61 0.00 -0.00 0.00 0.00 57.88 56.88 2qgp h LEU 55 Cb 1.16 0.09 -0.11 0.00 -0.00 0.00 0.00 40.66 41.80 2qgp h LEU 55 CO 0.75 -0.18 0.18 -0.69 -0.00 0.00 0.00 178.44 178.49 2qgp s VAL 56 N -3.35 4.96 0.25 1.22 1.01 -1.26 -5.02 120.40 118.22 2qgp s VAL 56 Ca -0.06 1.09 -0.31 0.00 0.00 0.00 0.00 61.98 62.70 2qgp s VAL 56 Cb 0.01 -3.96 -0.13 0.00 0.00 0.00 0.00 36.38 32.29 2qgp s VAL 56 CO 0.18 -0.03 1.39 -2.65 0.00 0.00 0.00 175.10 174.00 2qgp n PRO 57 N 5.78 2.06 -0.34 2.72 -0.02 -1.26 -3.96 135.00 139.98 2qgp n PRO 57 Ca -0.00 0.73 0.22 0.00 -2.02 0.00 0.00 63.50 62.43 2qgp n PRO 57 Cb 0.49 -2.38 0.47 0.00 -0.02 0.00 0.00 33.50 32.06 2qgp n PRO 57 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2qgp h VAL 58 N 2.98 0.45 0.18 -1.45 -1.51 -1.92 0.19 116.25 115.17 2qgp h VAL 58 Ca -0.45 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 64.87 2qgp h VAL 58 Cb 1.28 -0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 30.41 2qgp h VAL 58 CO 0.74 0.08 -0.16 0.58 -1.23 0.00 0.00 177.57 177.58 2qgp h VAL 59 N 0.42 0.65 0.00 7.19 2.07 -1.89 -1.81 116.25 122.89 2qgp h VAL 59 Ca 0.66 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.18 2qgp h VAL 59 Cb 1.53 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 2qgp h VAL 59 CO -0.44 0.00 0.00 0.54 0.02 0.00 0.00 177.57 177.69 2qgp n ARG 60 N -5.28 0.71 -0.36 1.57 1.74 -0.11 0.27 116.66 115.20 2qgp n ARG 60 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2qgp n ARG 60 Cb 0.20 -1.30 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 2qgp n ARG 60 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qgp n GLY 61 N 0.28 0.77 3.72 -0.13 0.00 -0.69 -4.85 105.19 104.29 2qgp n GLY 61 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2qgp n GLY 61 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qgp n GLY 62 N -2.24 0.50 3.71 -0.02 0.00 0.47 -4.93 105.19 102.69 2qgp n GLY 62 Ca 0.00 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 2qgp n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qgp s LYS 63 N -3.46 2.57 -1.13 1.61 -0.14 -1.26 -4.32 119.74 113.61 2qgp s LYS 63 Ca 0.82 -1.13 -0.05 0.00 -1.36 0.00 0.00 55.97 54.25 2qgp s LYS 63 Cb -0.37 -2.40 0.27 0.00 -1.68 0.00 0.00 37.83 33.65 2qgp s LYS 63 CO 0.41 0.43 1.57 0.43 -0.76 0.00 0.00 175.35 177.44 2qgp n SER 64 N -0.55 6.09 -4.42 2.83 7.64 -1.26 -4.65 113.62 119.30 2qgp n SER 64 Ca -0.08 -3.33 -0.21 0.00 1.01 0.00 0.00 58.87 56.25 2qgp n SER 64 Cb 0.56 -1.32 -0.10 0.00 -1.01 0.00 0.00 64.21 62.34 2qgp n SER 64 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2qgp s THR 65 N -1.99 1.69 0.59 0.44 -4.23 -1.26 -4.76 115.64 106.13 2qgp s THR 65 Ca 0.33 -2.15 0.30 0.00 -1.18 0.00 0.00 61.69 58.99 2qgp s THR 65 Cb 0.06 -2.40 0.35 0.00 1.34 0.00 0.00 72.50 71.85 2qgp s THR 65 CO 0.08 -0.34 2.26 0.03 -0.54 0.00 0.00 174.62 176.11 2qgp h ARG 66 N 2.31 0.00 -0.61 3.99 3.08 -1.93 0.42 114.38 121.64 2qgp h ARG 66 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 2qgp h ARG 66 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 2qgp h ARG 66 CO 0.66 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.98 2qgp n GLY 67 N -1.30 1.35 0.00 0.04 0.00 -1.26 -4.16 105.19 99.86 2qgp n GLY 67 Ca -0.03 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.66 2qgp n GLY 67 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2qgp n ASN 68 N 0.27 0.00 -4.47 1.61 4.05 0.04 -5.00 115.26 111.76 2qgp n ASN 68 Ca 0.10 0.00 -0.30 0.00 0.45 0.00 0.00 54.58 54.83 2qgp n ASN 68 Cb 0.46 0.00 -0.12 0.00 1.23 0.00 0.00 39.78 41.35 2qgp n ASN 68 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 2qgp s VAL 69 N 0.00 2.77 -0.04 3.44 -7.23 -0.62 0.61 120.40 119.34 2qgp s VAL 69 Ca 0.00 -1.38 -0.15 0.00 -1.81 0.00 0.00 61.98 58.64 2qgp s VAL 69 Cb 0.00 -2.22 0.03 0.00 0.56 0.00 0.00 36.38 34.75 2qgp s VAL 69 CO 0.00 0.21 0.34 0.54 -0.31 0.00 0.00 175.10 175.87 2qgp s VAL 70 N -1.04 0.04 0.24 1.32 0.11 0.55 -4.81 120.40 116.82 2qgp s VAL 70 Ca 0.16 -0.35 -0.30 0.00 -2.93 0.00 0.00 61.98 58.57 2qgp s VAL 70 Cb -0.10 -0.61 -0.10 0.00 -1.53 0.00 0.00 36.38 34.04 2qgp s VAL 70 CO 0.08 -0.19 1.36 -2.16 -3.33 0.00 0.00 175.10 170.85 2qgp s PRO 71 N -0.98 4.34 0.02 1.54 0.04 -1.26 -1.49 135.00 137.21 2qgp s PRO 71 Ca -0.10 2.17 -0.04 0.00 0.04 0.00 0.00 61.00 63.07 2qgp s PRO 71 Cb -0.04 -3.14 -0.01 0.00 0.04 0.00 0.00 34.50 31.35 2qgp s PRO 71 CO 0.04 -0.30 0.06 0.00 0.04 0.00 0.00 177.00 176.84 2qgp s ALA 72 N -0.16 -0.09 0.52 8.56 0.00 -0.36 -0.85 121.76 129.38 2qgp s ALA 72 Ca 0.56 -0.40 -0.05 0.00 0.00 0.00 0.00 51.96 52.06 2qgp s ALA 72 Cb -0.39 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 2qgp s ALA 72 CO 0.43 -0.21 0.83 0.00 0.00 0.00 0.00 175.76 176.80 2qgp h LYS 74 N 0.07 0.31 0.00 0.00 6.56 -1.95 -1.93 116.57 119.63 2qgp h LYS 74 Ca -0.46 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.11 2qgp h LYS 74 Cb 1.23 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.82 2qgp h LYS 74 CO 0.61 0.21 0.00 0.39 -2.06 0.00 0.00 179.45 178.60 2qgp n GLU 75 N -5.11 0.00 -0.31 3.15 -0.58 -1.26 -2.57 120.64 113.95 2qgp n GLU 75 Ca 0.23 0.00 0.15 0.00 -0.42 0.00 0.00 57.16 57.12 2qgp n GLU 75 Cb 0.69 -0.46 0.30 0.00 -0.57 0.00 0.00 31.44 31.40 2qgp n GLU 75 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qgp h ASN 77 N 0.00 0.27 0.00 0.00 -0.73 -1.42 0.35 115.58 114.05 2qgp h ASN 77 Ca 0.58 -0.00 -0.03 0.00 1.87 0.00 0.00 56.30 58.71 2qgp h ASN 77 Cb 1.24 -0.06 -0.00 0.00 0.27 0.00 0.00 38.32 39.76 2qgp h ASN 77 CO -0.84 0.19 -0.20 0.78 -0.37 0.00 0.00 177.43 176.99 2qgp h ASN 78 N 0.31 0.00 0.00 1.15 -0.26 -0.23 -3.10 115.58 113.46 2qgp h ASN 78 Ca 0.13 -0.66 0.00 0.00 -0.56 0.00 0.00 56.30 55.21 2qgp h ASN 78 Cb 0.13 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.39 2qgp h ASN 78 CO -0.03 0.94 0.06 0.54 -1.06 0.00 0.00 177.43 177.88 2qgp n ARG 79 N -4.62 0.07 -0.01 0.81 1.74 -0.85 0.60 116.66 114.40 2qgp n ARG 79 Ca -0.11 0.54 -0.17 0.00 -0.77 0.00 0.00 57.85 57.35 2qgp n ARG 79 Cb 0.39 -1.78 -0.13 0.00 -1.02 0.00 0.00 32.46 29.91 2qgp n ARG 79 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2qgp h LYS 80 N 0.00 0.20 0.00 5.56 3.64 -0.94 -1.89 116.57 123.13 2qgp h LYS 80 Ca 0.00 -0.28 -0.04 0.00 -1.27 0.00 0.00 60.65 59.06 2qgp h LYS 80 Cb 0.12 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2qgp h LYS 80 CO 0.00 1.08 -0.19 0.87 -2.27 0.00 0.00 179.45 178.94 2qgp h LYS 81 N -0.55 0.00 0.00 1.90 1.57 0.24 -3.37 116.57 116.37 2qgp h LYS 81 Ca -0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2qgp h LYS 81 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 2qgp h LYS 81 CO 0.08 0.19 -0.84 2.48 -0.57 0.00 0.00 179.45 180.79 2qgp n TYR 82 N -3.47 0.00 -1.48 -1.35 0.18 -0.46 -5.05 117.16 105.54 2qgp n TYR 82 Ca -0.01 0.00 -0.31 0.00 1.88 0.00 0.00 57.90 59.46 2qgp n TYR 82 Cb 0.36 0.00 0.07 0.00 -0.38 0.00 0.00 39.34 39.39 2qgp n TYR 82 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2qgp s LEU 83 N -2.83 3.13 0.68 -3.48 1.43 -0.71 -5.02 118.68 111.88 2qgp s LEU 83 Ca 0.00 1.75 -0.11 0.00 -1.03 0.00 0.00 54.13 54.74 2qgp s LEU 83 Cb 0.00 -4.51 -0.00 0.00 0.03 0.00 0.00 46.19 41.70 2qgp s LEU 83 CO 0.00 -1.71 1.06 -0.76 0.23 0.00 0.00 176.35 175.17 2qgp s LEU 84 N -5.59 3.10 0.54 1.79 1.02 -1.26 -4.70 118.68 113.58 2qgp s LEU 84 Ca 0.60 1.48 0.24 0.00 0.02 0.00 0.00 54.13 56.47 2qgp s LEU 84 Cb -0.16 -4.39 1.40 0.00 0.02 0.00 0.00 46.19 43.06 2qgp s LEU 84 CO 0.53 -1.27 2.04 -0.65 0.02 0.00 0.00 176.35 177.02 2qgp h PRO 85 N -0.60 0.00 0.20 1.29 0.11 -1.96 0.30 132.00 131.33 2qgp h PRO 85 Ca -0.44 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.38 2qgp h PRO 85 Cb 1.21 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.35 2qgp h PRO 85 CO 0.59 0.00 -1.26 -0.24 -0.21 0.00 0.00 178.00 176.88 2qgp h VAL 86 N 0.00 1.34 -0.35 3.15 3.04 -1.97 -3.28 116.25 118.18 2qgp h VAL 86 Ca 0.17 -2.60 -0.14 0.00 -1.01 0.00 0.00 66.70 63.13 2qgp h VAL 86 Cb 0.72 3.00 -0.01 0.00 -2.01 0.00 0.00 31.29 32.99 2qgp h VAL 86 CO -0.00 0.77 -0.34 -0.33 -1.01 0.00 0.00 177.57 176.66 2qgp h GLU 87 N 0.05 0.78 0.00 4.17 4.39 -1.56 -2.68 114.58 119.73 2qgp h GLU 87 Ca -0.21 -0.38 -0.00 0.00 0.34 0.00 0.00 59.36 59.11 2qgp h GLU 87 Cb 1.98 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.63 2qgp h GLU 87 CO 0.24 1.00 -0.02 2.35 -1.16 0.00 0.00 179.01 181.43 2qgp h TRP 88 N 0.65 0.00 -0.49 4.33 -0.00 -0.59 0.31 115.95 120.17 2qgp h TRP 88 Ca 0.07 0.00 -0.11 0.00 -0.00 0.00 0.00 58.89 58.85 2qgp h TRP 88 Cb 0.88 0.00 -0.07 0.00 -0.00 0.00 0.00 29.16 29.98 2qgp h TRP 88 CO 0.05 0.02 0.09 0.39 -0.00 0.00 0.00 178.44 178.99 2qgp n GLU 89 N -3.35 3.27 0.00 2.65 1.02 -1.02 -3.39 120.64 119.83 2qgp n GLU 89 Ca -0.03 -3.03 0.00 0.00 -0.02 0.00 0.00 57.16 54.09 2qgp n GLU 89 Cb 0.12 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.51 2qgp n GLU 89 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2qgp n GLU 90 N -0.36 2.32 0.07 3.49 1.02 -0.02 -4.14 120.64 123.02 2qgp n GLU 90 Ca 0.31 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.33 2qgp n GLU 90 Cb 1.14 -0.91 -0.08 0.00 -0.02 0.00 0.00 31.44 31.56 2qgp n GLU 90 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 2qgp h TYR 91 N 0.00 -0.21 -0.68 -0.32 3.20 -1.37 -2.26 116.97 115.34 2qgp h TYR 91 Ca 0.00 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.91 2qgp h TYR 91 Cb 0.83 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 39.11 2qgp h TYR 91 CO 0.00 0.22 0.40 -0.07 -1.64 0.00 0.00 178.16 177.07 2qgp h LEU 92 N -0.75 0.62 -0.97 2.82 3.38 -1.81 -0.91 115.31 117.68 2qgp h LEU 92 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qgp h LEU 92 Cb 0.52 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2qgp h LEU 92 CO 0.04 0.41 0.00 0.47 0.09 0.00 0.00 178.44 179.45 2qgp n ASP 93 N -4.74 1.13 -0.32 -0.43 9.92 -1.21 -5.03 116.55 115.87 2qgp n ASP 93 Ca 0.08 -2.06 0.04 0.00 -0.53 0.00 0.00 54.79 52.32 2qgp n ASP 93 Cb 0.14 -0.41 0.03 0.00 -0.64 0.00 0.00 41.12 40.25 2qgp n ASP 93 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79